Crystallography Open Database

Information card for entry 4510591

Preview

Coordinates	4510591.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H20 Ag7 Ge N28 O47 W12
Calculated formula	C36 H20 Ag7 Ge N28 O47 W12
Title of publication	Assembly of Polyoxometalate-Based Hybrids with Different Helical Channels upon Subtle Ligand Variation
Authors of publication	Li, Meng-Ting; Sha, Jing-Quan; Zong, Xi-Ming; Sun, Jing-Wen; Yan, Peng-Fei; Li, Liang; Yang, Xiao-Ning
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	6
Pages of publication	2794
a	12.387 ± 0.005 Å
b	13.14 ± 0.005 Å
c	14.969 ± 0.005 Å
α	104.87 ± 0.005°
β	99.856 ± 0.005°
γ	116.097 ± 0.005°
Cell volume	1998.3 ± 1.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0801
Residual factor for significantly intense reflections	0.0713
Weighted residual factors for significantly intense reflections	0.141
Weighted residual factors for all reflections included in the refinement	0.1451
Goodness-of-fit parameter for all reflections included in the refinement	1.203
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4510591.cif
119055	2014-07-05	cif/ Updating files of 4510589, 4510590, 4510591 Original log message: Adding full bibliography for 4510589--4510591.cif.	4510591.cif
112925	2014-05-07	cif/ Adding structures of 4510589, 4510590, 4510591 via cif-deposit CGI script.	4510591.cif